5-butyl-3-chloranyl-6-(4-chlorophenyl)sulfanyl-1-(phenylmethyl)pyridazin-4-one

Systemtic Name: 5-butyl-3-chloranyl-6-(4-chlorophenyl)sulfanyl-1-(phenylmethyl)pyridazin-4-one Openeye Name: 1-benzyl-5-butyl-3-chloro-6-(4-chlorophenyl)sulfanyl-pyridazin-4-one CAS Name: 5-butyl-3-chloro-6-[(4-chlorophenyl)thio]-1-(phenylmethyl)-4-pyridazinone IUPAC Name: 1-benzyl-5-butyl-3-chloro-6-(4-chlorophenyl)sulfanylpyridazin-4-one Traditional Name: 1-benzyl-5-butyl-3-chloro-6-[(4-chlorophenyl)thio]pyridazin-4-one Formula: C21H20Cl2N2OS MolecularWeight: 419.3673

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N=C(C1=O)Cl)CC2=CC=CC=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1=C(N(N=C(C1=O)Cl)CC2=CC=CC=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20Cl2N2OS/c1-2-3-9-18-19(26)20(23)24-25(14-15-7-5-4-6-8-15)21(18)27-17-12-10-16(22)11-13-17/h4-8,10-13H,2-3,9,14H2,1H3